ethyl 6-(4-methoxyphenyl)-4-[3-(4-methylphenyl)-5-oxidanylidene-2H-1,2,3-oxadiazol-3-ium-4-yl]-2-oxidanylidene-cyclohex-3-ene-1-carboxylate

Systemtic Name: ethyl 6-(4-methoxyphenyl)-4-[3-(4-methylphenyl)-5-oxidanylidene-2H-1,2,3-oxadiazol-3-ium-4-yl]-2-oxidanylidene-cyclohex-3-ene-1-carboxylate Openeye Name: ethyl 6-(4-methoxyphenyl)-2-oxo-4-[5-oxo-3-(p-tolyl)-2H-oxadiazol-3-ium-4-yl]cyclohex-3-ene-1-carboxylate CAS Name: 6-(4-methoxyphenyl)-4-[3-(4-methylphenyl)-5-oxo-2H-oxadiazol-3-ium-4-yl]-2-oxo-1-cyclohex-3-enecarboxylic acid ethyl ester IUPAC Name: ethyl 6-(4-methoxyphenyl)-4-[3-(4-methylphenyl)-5-oxo-2H-oxadiazol-3-ium-4-yl]-2-oxocyclohex-3-ene-1-carboxylate Traditional Name: 2-keto-4-[5-keto-3-(p-tolyl)-2H-oxadiazol-3-ium-4-yl]-6-(4-methoxyphenyl)cyclohex-3-ene-1-carboxylic acid ethyl ester Formula: C25H25N2O6+ MolecularWeight: 449.4758

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1C(CC(=CC1=O)C2=[N+](NOC2=O)C3=CC=C(C=C3)C)C4=CC=C(C=C4)OC

Isomeric SMILES

CCOC(=O)C1C(CC(=CC1=O)C2=[N+](NOC2=O)C3=CC=C(C=C3)C)C4=CC=C(C=C4)OC

InChI

InChI=1S/C25H24N2O6/c1-4-32-24(29)22-20(16-7-11-19(31-3)12-8-16)13-17(14-21(22)28)23-25(30)33-26-27(23)18-9-5-15(2)6-10-18/h5-12,14,20,22H,4,13H2,1-3H3/p+1